hexyl 7-ethynyl-4-(6-ethynyl-3-hexoxycarbonyl-2-oxidanyl-naphthalen-1-yl)-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: hexyl 7-ethynyl-4-(6-ethynyl-3-hexoxycarbonyl-2-oxidanyl-naphthalen-1-yl)-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: hexyl 7-ethynyl-4-(6-ethynyl-3-hexoxycarbonyl-2-hydroxy-1-naphthyl)-3-hydroxy-naphthalene-2-carboxylate CAS Name: 7-ethynyl-4-[6-ethynyl-3-[hexoxy(oxo)methyl]-2-hydroxy-1-naphthalenyl]-3-hydroxy-2-naphthalenecarboxylic acid hexyl ester IUPAC Name: hexyl 7-ethynyl-4-(6-ethynyl-3-hexoxycarbonyl-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylate Traditional Name: 7-ethynyl-4-(6-ethynyl-3-hexoxycarbonyl-2-hydroxy-1-naphthyl)-3-hydroxy-naphthalene-2-carboxylic acid hexyl ester Formula: C38H38O6 MolecularWeight: 590.70472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(C(=C2C=CC(=CC2=C1)C#C)C3=C4C=CC(=CC4=CC(=C3O)C(=O)OCCCCCC)C#C)O

Isomeric SMILES

CCCCCCOC(=O)C1=C(C(=C2C=CC(=CC2=C1)C#C)C3=C4C=CC(=CC4=CC(=C3O)C(=O)OCCCCCC)C#C)O

InChI

InChI=1S/C38H38O6/c1-5-9-11-13-19-43-37(41)31-23-27-21-25(7-3)15-17-29(27)33(35(31)39)34-30-18-16-26(8-4)22-28(30)24-32(36(34)40)38(42)44-20-14-12-10-6-2/h3-4,15-18,21-24,39-40H,5-6,9-14,19-20H2,1-2H3